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{
"id": "jvasp-95145",
"created_at": "2022-09-04T14:36:31.553091Z",
"updated_at": "2022-09-04T14:36:31.553114Z",
"structure_string": "Cd10 I20\n1.0\n4.286487 0.000000 -0.000000\n-2.143244 3.712207 0.000000\n-0.000000 -0.000000 68.783737\nCd I\n10 20\ndirect\n0.666668 0.333333 0.524992 Cd\n0.000000 0.000000 0.124988 Cd\n0.000000 0.000000 0.324988 Cd\n0.666668 0.333333 0.024994 Cd\n0.000000 0.000000 0.924979 Cd\n0.000000 0.000000 0.624983 Cd\n0.000000 0.000000 0.825001 Cd\n0.666668 0.333333 0.724991 Cd\n0.666668 0.333333 0.224988 Cd\n0.666668 0.333333 0.425008 Cd\n0.666668 0.333333 0.599789 I\n0.666668 0.333333 0.799800 I\n0.333334 0.666668 0.650208 I\n0.333334 0.666668 0.850218 I\n0.000000 0.000000 0.699797 I\n0.000000 0.000000 -0.000202 I\n0.333334 0.666668 0.250214 I\n0.333334 0.666668 0.150212 I\n0.333334 0.666668 0.550216 I\n0.666668 0.333333 0.899781 I\n0.333334 0.666668 0.050218 I\n0.000000 0.000000 0.399807 I\n0.333334 0.666668 0.350213 I\n0.333334 0.666668 0.750216 I\n0.666668 0.333333 0.099793 I\n0.333334 0.666668 0.950204 I\n0.333334 0.666668 0.450225 I\n0.000000 0.000000 0.199794 I\n0.666668 0.333333 0.299792 I\n0.000000 0.000000 0.499795 I\n",
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{
"id": "jvasp-99491",
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"structure_string": "Mg5 Hg1\n1.0\n8.127449 0.040289 0.000000\n-7.475020 3.190787 0.000000\n0.000000 0.000000 5.002721\nMg Hg\n5 1\ndirect\n0.000894 0.999108 0.500000 Mg\n0.671329 0.328672 0.500000 Mg\n0.335086 0.664915 0.500000 Mg\n0.556312 0.443689 -0.000000 Mg\n0.882064 0.117937 -0.000000 Mg\n0.220988 0.779013 -0.000000 Hg\n",
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{
"id": "jvasp-14671",
"created_at": "2022-09-04T14:36:31.615340Z",
"updated_at": "2022-09-04T14:36:31.615375Z",
"structure_string": "Zr5 Te4\n1.0\n3.762101 -0.000000 0.948897\n1.881051 7.679840 0.474448\n0.002824 0.000000 7.921072\nZr Te\n5 4\ndirect\n0.000000 0.000000 0.000000 Zr\n0.309682 0.058459 0.322176 Zr\n0.631859 0.677824 0.058459 Zr\n0.368140 0.322176 0.941542 Zr\n0.690316 0.941541 0.677825 Zr\n0.051694 0.230265 0.666346 Te\n0.718040 0.333654 0.230266 Te\n0.281959 0.666346 0.769735 Te\n0.948304 0.769735 0.333655 Te\n",
"nsites": 9,
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"density": 7.013461440181702,
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"volume": 228.83767627995277,
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"formula_full": "Zr5 Te4",
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{
"id": "jvasp-104137",
"created_at": "2022-09-04T14:36:31.688975Z",
"updated_at": "2022-09-04T14:36:31.689008Z",
"structure_string": "H24 C28\n1.0\n4.558809 -0.006984 -0.913764\n-2.362467 8.455260 -0.452774\n-0.051798 -0.116614 11.506458\nH C\n24 28\ndirect\n0.509404 0.230999 0.181626 H\n0.441442 0.451094 0.808903 H\n0.440935 0.451185 0.308911 H\n0.507633 0.984773 0.017264 H\n0.507238 0.985357 0.517484 H\n0.056679 0.597114 0.272299 H\n0.123413 0.130707 0.980673 H\n0.123246 0.130933 0.480613 H\n0.054758 0.350830 0.107969 H\n0.054778 0.351099 0.607897 H\n0.550523 0.797323 0.354851 H\n0.551512 0.796666 0.854624 H\n0.057413 0.596656 0.772061 H\n0.600817 0.504833 0.618868 H\n0.963845 0.077183 0.670679 H\n0.963358 0.077303 0.170643 H\n0.537031 0.605292 0.992699 H\n0.537091 0.605614 0.492657 H\n0.027566 0.976397 0.796890 H\n0.027265 0.976580 0.296869 H\n0.013803 0.784558 0.934711 H\n0.013122 0.785357 0.434926 H\n0.510096 0.230994 0.681608 H\n0.600982 0.504555 0.118918 H\n0.999105 0.676582 0.097541 C\n0.565519 0.905264 0.692023 C\n0.565203 0.905311 0.192026 C\n0.743490 0.417273 0.467362 C\n0.743709 0.417076 0.967396 C\n0.592755 0.381247 0.846790 C\n0.630603 0.257068 0.775338 C\n0.129699 0.787903 0.527578 C\n0.129984 0.787443 0.027465 C\n0.592311 0.381360 0.346782 C\n0.999139 0.676746 0.597522 C\n0.630052 0.257139 0.275338 C\n0.821124 0.164722 0.822183 C\n0.862961 0.030133 0.744212 C\n0.434331 0.794445 0.262100 C\n0.434949 0.794113 0.761969 C\n0.934261 0.324743 0.014238 C\n0.934109 0.324964 0.514188 C\n0.155891 0.681724 0.215737 C\n0.156375 0.681499 0.715598 C\n0.972109 0.200561 0.942787 C\n0.971850 0.200747 0.442742 C\n0.701771 0.551626 0.045370 C\n0.701698 0.551877 0.545333 C\n0.408277 0.900513 0.573948 C\n0.862552 0.030257 0.244194 C\n0.820689 0.164838 0.322162 C\n0.408418 0.900166 0.073828 C\n",
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{
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"created_at": "2022-09-04T14:36:31.708078Z",
"updated_at": "2022-09-04T14:36:31.708132Z",
"structure_string": "Er1 Pt5\n1.0\n-0.000000 0.000000 -4.478991\n-2.660587 -4.608273 0.000000\n-2.660587 4.608273 0.000000\nEr Pt\n1 5\ndirect\n0.000000 0.000000 0.000000 Er\n0.500000 0.500001 0.500001 Pt\n0.500000 0.000000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.000000 0.666668 0.333334 Pt\n0.000000 0.333334 0.666668 Pt\n",
"nsites": 6,
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{
"id": "jvasp-78453",
"created_at": "2022-09-04T14:36:31.791304Z",
"updated_at": "2022-09-04T14:36:31.791323Z",
"structure_string": "Ir1 C1\n1.0\n-2.208957 -2.208956 0.000000\n-2.208956 -0.000000 -2.208956\n-0.000000 -2.208956 -2.208956\nIr C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ir\n0.500001 0.500001 0.500001 C\n",
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{
"id": "jvasp-101392",
"created_at": "2022-09-04T14:36:31.838009Z",
"updated_at": "2022-09-04T14:36:31.838035Z",
"structure_string": "Cd3 Bi1\n1.0\n4.323193 0.123596 -3.811725\n-0.801717 4.250003 -3.811725\n-0.099515 -0.123596 5.762754\nCd Bi\n3 1\ndirect\n0.749999 0.250000 0.500000 Cd\n0.249999 0.749999 0.499999 Cd\n0.499999 0.500000 0.000001 Cd\n0.000000 0.000000 0.000000 Bi\n",
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{
"id": "jvasp-78489",
"created_at": "2022-09-04T14:36:31.899800Z",
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"structure_string": "Er1 Pd2\n1.0\n3.949750 0.000000 0.000000\n0.000000 3.949750 0.000000\n-1.974875 -1.974875 4.090753\nEr Pd\n1 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.250000 0.750000 0.500000 Pd\n0.750000 0.250000 0.500000 Pd\n",
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{
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"structure_string": "Dy1 Cu5\n1.0\n5.025033 -0.000000 -0.000000\n-2.512517 4.351807 -0.000000\n0.000000 -0.000000 4.102863\nDy Cu\n1 5\ndirect\n0.000000 0.000000 0.000000 Dy\n0.666667 0.333333 0.000000 Cu\n0.333333 0.666668 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.500000 0.000000 0.500000 Cu\n-0.000000 0.500000 0.500000 Cu\n",
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{
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"structure_string": "Pb2 I4\n1.0\n4.540484 0.008731 13.636269\n2.217816 3.961989 13.636269\n0.014861 0.008731 14.372321\nPb I\n2 4\ndirect\n0.416981 0.416980 0.416981 Pb\n0.583020 0.583019 0.583020 Pb\n0.871610 0.871609 0.871610 I\n0.128391 0.128391 0.128391 I\n0.705568 0.705568 0.705568 I\n0.294432 0.294432 0.294432 I\n",
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{
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"structure_string": "Sr2 Hg4\n1.0\n4.669017 -0.000000 2.012602\n2.068297 5.811086 1.623883\n0.019301 0.113644 6.377326\nSr Hg\n2 4\ndirect\n0.485475 0.264525 0.764526 Sr\n0.514526 0.735475 0.235474 Sr\n0.833620 0.683605 0.649155 Hg\n0.166381 0.850844 0.816395 Hg\n0.833620 0.149156 0.183605 Hg\n0.166381 0.316395 0.350844 Hg\n",
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{
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"structure_string": "Tc1 Ir1\n1.0\n2.757451 -0.000000 -0.000000\n-1.378725 2.388024 -0.000000\n0.000000 0.000000 4.387477\nTc Ir\n1 1\ndirect\n0.666666 0.333332 0.000000 Tc\n0.000000 0.000000 0.500000 Ir\n",
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